SCHEMBL1373345

SCHEMBL1373345

CC(=O)OCCS(=O)(=O)c1cc[c]cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.50
ALDH1A1 P00352 3/20 0.41
KMT2A Q03164 3/20 0.41
HTT P42858 2/20 0.41
GAA P10253 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 1/20 0.41
TP53 P04637 1/20 0.41
POLB P06746 2/20 0.37
MAPT P10636 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
KDM4E B2RXH2 1/20 0.36
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
PGR P06401 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
HTR1A P08908 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12237322 0.83 CA2 (0.53) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL9330254 0.81 CA2 (0.46) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL4067415 0.81 ALDH1A1 (0.56) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL15833291 0.81 CA2 (0.51) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL5711929 0.80 CA2 (0.54) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL8752139 0.80 CA2 (0.54) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL12237305 0.80 GAA (0.51) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL13434032 0.79 HTT (0.62) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL4611003 0.77 CA2 (0.35) CA2ALDH1A1KMT2AHTTGAA
SCHEMBL14816982 0.76 PKM (0.49) CA2ALDH1A1KMT2ALMNAMEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 120 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934293-B2 AZO REACTIVE DYES AND MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIB GMBH (DE) 2020-12-09 EP disclosed
US-10190255-B2 Mixtures of fiber-reactive azo dyes, their preparation and their use DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2019-01-29 US disclosed
US-10138596-B2 Mixtures of fiber-reactive azo dyes, their preparation and their use DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2018-11-27 US disclosed
EP-2912119-B1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIB GMBH (DE) 2016-12-14 EP disclosed
US-20150284904-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-10-08 US disclosed
US-20150267345-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-09-24 US disclosed
EP-2912119-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DyStar Colours Distribution GmbH (DE) 2015-09-02 EP disclosed
EP-2912118-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DyStar Colours Distribution GmbH (DE) 2015-09-02 EP disclosed
US-9062208-B2 Fiber-reactive copper complex disazo dyes DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2015-06-23 US disclosed
WO-2014063822-A1 MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR COLOURS DISTRIBUTION GMBH (DE) 2014-05-01 WO disclosed
EP-0537220-B1 DIAZO COMPOUNDS, METHOD FOR PREPARING THEM, AND THEIR USE AS DYES HOECHST AG (DE) 1994-07-27 EP disclosed
EP-0603595-A1 Fibre reactive dyes, method for their preparation and their use HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-29 EP disclosed
US-5290922-A Disazo compounds containing a cyanoamidotriazinyl radical as a bridging member (middle component) and fiber-reactive groups of the vinylsulfone series, suitable as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-01 US disclosed
US-5290923-A Fiber-reactive dyes for cellulose; strong, fast shades HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-01 US disclosed
US-5280110-A Fiber-reactive dye HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-18 US disclosed
US-5225544-A FIBER REACTIVE DYES WHICH CONTAIN A CYANOAMINOTRIAZINYL GROUP AND ONE OR TWO GROUPS OF THE VINYL SULFONE SERIES HOECHST AKTIENGESELLSCHAFT (DE) 1993-07-06 US disclosed
EP-0548792-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
EP-0548795-A2 Water-soluble reactive dyes, their manufacture and their use HOECHST AKTIENGESELLSCHAFT (DE) 1993-06-30 EP disclosed
WO-1992001021-A1 DIAZO COMPOUNDS, METHOD FOR PREPARING THEM, AND THEIR USE AS DYES HOECHST AKTIENGESELLSCHAFT (DE) 1992-01-23 WO disclosed
US-4260776-A PYRAZOLONE BAYER AKTIENGESELLSCHAFT (DE) 1981-04-07 US disclosed